List of Articles Density function theory

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  1 - A computational study of Nitramide adsorption on the surface of pristine and Ni functionalized (4,4) armchair Gallium nitride nanotubes
  Mahdi Rezaei Sameti
• Open Access Article
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  2 - Investigating the Possibility of Measuring Phenolic Compounds in Brown Sugar by DFT Method
  P. Mesgaran Karimi M. Honarvar
• Open Access Article
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  3 - Investigation of C-O tautomerism in a derivative of Flucytosine: A DFT study
  بهزاد چهکندی
• Open Access Article
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  4 - The Study of absorption of drug anticancer Chlorambucil on Graphene: A DFT Study
  abolghasem shameli Ebrahim balali
• Open Access Article
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  5 - Computational study of the effect of tin oxide nanoparticles on the thermodynamic properties of Mephedrone
  Roya Ahmadi ashraf Sadat Shah Velayatih Shabnam Shashmani Masoumeh Simin Ghad